[2,3-bis(4-tert-butylphenyl)phenyl]sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: [2,3-bis(4-tert-butylphenyl)phenyl]sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: [2,3-bis(4-tert-butylphenyl)phenyl]sulfonium; trifluoromethanesulfonate CAS Name: [2,3-bis(4-tert-butylphenyl)phenyl]sulfonium; trifluoromethanesulfonate IUPAC Name: [2,3-bis(4-tert-butylphenyl)phenyl]sulfanium; trifluoromethanesulfonate Traditional Name: [2,3-bis(4-tert-butylphenyl)phenyl]sulfonium triflate Formula: C27H31F3O3S2 MolecularWeight: 524.65845

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=CC=C2)[SH2+])C3=CC=C(C=C3)C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=CC=C2)[SH2+])C3=CC=C(C=C3)C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C26H30S.CHF3O3S/c1-25(2,3)20-14-10-18(11-15-20)22-8-7-9-23(27)24(22)19-12-16-21(17-13-19)26(4,5)6;2-1(3,4)8(5,6)7/h7-17,27H,1-6H3;(H,5,6,7)